Ligand name: propan-2-yl 2-[[4-[2-(dimethylamino)ethyl-methyl-amino]-2-methoxy-5-(propanoylamino)phenyl]amino]-4-(1-methylindol-3-yl)pyrimidine-5-carboxylate
PDB ligand accession: R28
DrugBank: n/a
PubChem: 162639267
ChEMBL: n/a
InChI Key: CINKQTDSFCVDKO-UHFFFAOYSA-N
SMILES: CCC(=O)Nc1cc(c(cc1N(C)CCN(C)C)OC)Nc2ncc(c(n2)c3cn(c4c3cccc4)C)C(=O)OC(C)C
Drug action: n/a

List of PDB structures and/or AlphaFold models with target protein P00533

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
8F1X	Download	Experimental	e8f1xA1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot
7T4I	Download	Experimental	e7t4iA1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot
7A6K	Download	Experimental	e7a6kA1 e7a6kB1 e7a6kC1 e7a6kC1 e7a6kD1	Protein kinase/SAICAR synthase/ATP-grasp Protein kinase/SAICAR synthase/ATP-grasp Protein kinase/SAICAR synthase/ATP-grasp Protein kinase/SAICAR synthase/ATP-grasp Protein kinase/SAICAR synthase/ATP-grasp	LigPlot
7B85	Download	Experimental	e7b85A1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot
7T4J	Download	Experimental	e7t4jA1 e7t4jB1 e7t4jB1	Protein kinase/SAICAR synthase/ATP-grasp Protein kinase/SAICAR synthase/ATP-grasp Protein kinase/SAICAR synthase/ATP-grasp	LigPlot